3-(furan-2-yl)-1-(3-piperidin-1-ylsulfonylphenyl)pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-(furan-2-yl)-1-(3-piperidin-1-ylsulfonylphenyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-(2-furyl)-1-[3-(1-piperidylsulfonyl)phenyl]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-(2-furanyl)-1-[3-(1-piperidinylsulfonyl)phenyl]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-(furan-2-yl)-1-(3-piperidin-1-ylsulfonylphenyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-(2-furyl)-1-(3-piperidinosulfonylphenyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C27H22N4O3S MolecularWeight: 482.55358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=CC(=C(C4=NC5=CC=CC=C5N34)C#N)C6=CC=CO6

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=CC(=C(C4=NC5=CC=CC=C5N34)C#N)C6=CC=CO6

InChI

InChI=1S/C27H22N4O3S/c28-18-22-21(26-12-7-15-34-26)17-25(31-24-11-3-2-10-23(24)29-27(22)31)19-8-6-9-20(16-19)35(32,33)30-13-4-1-5-14-30/h2-3,6-12,15-17H,1,4-5,13-14H2